COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.588   0.169  -1.255  1.00  0.00           C  
HETATM    2  C   UNL     1       2.244  -0.420  -0.005  1.00  0.00           C  
HETATM    3  C   UNL     1       2.923   0.073   2.266  1.00  0.00           C  
HETATM    4  C   UNL     1       3.658  -0.832  -0.325  1.00  0.00           C  
HETATM    5  C   UNL     1      -1.900   0.341  -0.319  1.00  0.00           C  
HETATM    6  C   UNL     1      -0.415   1.731  -1.130  1.00  0.00           C  
HETATM    7  C   UNL     1       0.156   0.525  -0.951  1.00  0.00           C  
HETATM    8  N   UNL     1      -0.774  -0.305  -0.454  1.00  0.00           N  
HETATM    9  O   UNL     1      -3.332  -0.271   1.708  1.00  0.00           O  
HETATM   10  O   UNL     1      -4.451   0.264  -0.462  1.00  0.00           O  
HETATM   11  C   UNL     1       2.891   1.833   0.603  1.00  0.00           C  
HETATM   12  N   UNL     1      -1.719   1.615  -0.730  1.00  0.00           N  
HETATM   13  N   UNL     1       2.258   0.589   1.063  1.00  0.00           N  
HETATM   14  O   UNL     1       4.584  -0.152   0.048  1.00  0.00           O  
HETATM   15  O   UNL     1       3.888  -1.953  -1.026  1.00  0.00           O  
HETATM   16  O   UNL     1      -3.414  -1.816  -0.071  1.00  0.00           O  
HETATM   17  S   UNL     1      -3.407  -0.338   0.290  1.00  0.00           S  
HETATM   18  H   UNL     1       2.128   1.065  -1.561  1.00  0.00           H  
HETATM   19  H   UNL     1       1.617  -0.565  -2.060  1.00  0.00           H  
HETATM   20  H   UNL     1       1.678  -1.291   0.326  1.00  0.00           H  
HETATM   21  H   UNL     1       2.750   0.756   3.098  1.00  0.00           H  
HETATM   22  H   UNL     1       2.519  -0.909   2.513  1.00  0.00           H  
HETATM   23  H   UNL     1       3.994  -0.010   2.082  1.00  0.00           H  
HETATM   24  H   UNL     1       0.063   2.619  -1.516  1.00  0.00           H  
HETATM   25  H   UNL     1       3.930   1.635   0.339  1.00  0.00           H  
HETATM   26  H   UNL     1       2.359   2.210  -0.270  1.00  0.00           H  
HETATM   27  H   UNL     1       2.854   2.575   1.400  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.389   2.317  -0.739  1.00  0.00           H  
HETATM   29  H   UNL     1       4.811  -2.176  -1.207  1.00  0.00           H  
HETATM   30  H   UNL     1      -4.206  -2.288   0.221  1.00  0.00           H  
CONECT    1    2    7   18   19                                       
CONECT    2   13    4    1   20                                       
CONECT    3   13   21   22   23                                       
CONECT    4    2   14   14   15                                       
CONECT    5    8    8   17   12                                       
CONECT    6    7    7   12   24                                       
CONECT    7    8    1    6    6                                       
CONECT    8    7    5    5                                            
CONECT    9   17   17                                                 
CONECT   10   17   17                                                 
CONECT   11   13   25   26   27                                       
CONECT   12    5    6   28                                            
CONECT   13    3   11    2                                            
CONECT   14    4    4                                                 
CONECT   15    4   29                                                 
CONECT   16   17   30                                                 
CONECT   17    9    9    5   10                                       
CONECT   17   10   16                                                 
CONECT   18    1                                                      
CONECT   19    1                                                      
CONECT   20    2                                                      
CONECT   21    3                                                      
CONECT   22    3                                                      
CONECT   23    3                                                      
CONECT   24    6                                                      
CONECT   25   11                                                      
CONECT   26   11                                                      
CONECT   27   11                                                      
CONECT   28   12                                                      
CONECT   29   15                                                      
CONECT   30   16                                                      
MASTER        0    0    0    0    0    0    0    0   30    0   30    0
END
